# generated using pymatgen
data_Nb4ReO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.12805900
_cell_length_b   5.47497756
_cell_length_c   8.80925726
_cell_angle_alpha   84.41447180
_cell_angle_beta   79.78109939
_cell_angle_gamma   75.75227556
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb4ReO4
_chemical_formula_sum   'Nb8 Re2 O8'
_cell_volume   235.54473594
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Nb  Nb0  1  0.39014600  0.86400500  0.64024800  1.0
  Nb  Nb1  1  0.15574700  0.17743400  0.20681500  1.0
  Nb  Nb2  1  0.78569900  0.30329100  0.95797500  1.0
  Nb  Nb3  1  0.21430100  0.69670900  0.04202500  1.0
  Nb  Nb4  1  0.92358700  0.25933200  0.62622600  1.0
  Nb  Nb5  1  0.07641300  0.74066800  0.37377400  1.0
  Nb  Nb6  1  0.84425300  0.82256600  0.79318500  1.0
  Nb  Nb7  1  0.60985400  0.13599500  0.35975200  1.0
  Re  Re8  1  0.66798400  0.68665900  0.19205500  1.0
  Re  Re9  1  0.33201600  0.31334100  0.80794500  1.0
  O  O10  1  0.19503600  0.08918700  0.98505100  1.0
  O  O11  1  0.80496400  0.91081300  0.01494900  1.0
  O  O12  1  0.78673600  0.94002100  0.55106900  1.0
  O  O13  1  0.21326400  0.05997900  0.44893100  1.0
  O  O14  1  0.36594700  0.46816400  0.24186600  1.0
  O  O15  1  0.63405300  0.53183600  0.75813400  1.0
  O  O16  1  0.16862300  0.57515100  0.62997100  1.0
  O  O17  1  0.83137700  0.42484900  0.37002900  1.0